(2R)-2-[(4-fluorophenyl)sulfonyl-(pyridin-3-ylmethyl)amino]-3-methyl-butanoic acid

Systemtic Name: (2R)-2-[(4-fluorophenyl)sulfonyl-(pyridin-3-ylmethyl)amino]-3-methyl-butanoic acid Openeye Name: (2R)-2-[(4-fluorophenyl)sulfonyl-(3-pyridylmethyl)amino]-3-methyl-butanoic acid CAS Name: (2R)-2-[(4-fluorophenyl)sulfonyl-(3-pyridinylmethyl)amino]-3-methylbutanoic acid IUPAC Name: (2R)-2-[(4-fluorophenyl)sulfonyl-(pyridin-3-ylmethyl)amino]-3-methylbutanoic acid Traditional Name: (2R)-2-[(4-fluorophenyl)sulfonyl-(3-pyridylmethyl)amino]-3-methyl-butyric acid Formula: C17H19FN2O4S MolecularWeight: 366.407163

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)N(CC1=CN=CC=C1)S(=O)(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CC(C)[C@H](C(=O)O)N(CC1=CN=CC=C1)S(=O)(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C17H19FN2O4S/c1-12(2)16(17(21)22)20(11-13-4-3-9-19-10-13)25(23,24)15-7-5-14(18)6-8-15/h3-10,12,16H,11H2,1-2H3,(H,21,22)/t16-/m1/s1